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| CAS No.: | 79583-67-8 |
|---|---|
| Name: | AZIDOPROPIONICACID |
| Article Data: | 49 |
| Molecular Structure: | |
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| Formula: | C3H5N3O2 |
| Molecular Weight: | 115.092 |
| Synonyms: | 18523-47-2;Azidopropionic acid; |
| PSA: | 87.05000 |
| LogP: | 0.22416 |
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Specification
This chemical is called 3-Azidopropanoic acid, and it's also named as Azidopropionic acid. With the molecular formula of C3H5N3O2, its molecular weight is 115.09. The CAS registry number of this chemical is 79583-67-8.
Other characteristics of the 3-Azidopropanoic acid can be summarised as followings: (1)ACD/LogP: 0.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.44; (4)ACD/LogD (pH 7.4): -3.19; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 38.66 Å2.
You can still convert the following datas into molecular structure:
1.SMILES: [N-]=[N+]=N\CCC(=O)O
2.InChI: InChI=1/C3H5N3O2/c4-6-5-2-1-3(7)8/h1-2H2,(H,7,8)
3.InChIKey: YIPVUXAMZQBALD-UHFFFAOYAI